The excitation energy on EOM-CCSD QM/MM calculation?

From NWChem

You are viewing a single post from the thread title above
Jump to: navigation, search
Forum >> NWChem's corner >> QMMM >> The excitation energy on EOM-CCSD QM/MM calculation?

Click here for full thread
Clicked A Few Times
Threads 12
Posts 43
4:15:16 AM PST - Tue, Nov 13th 2012
Thanks
Thank you Karol for your instruction in reading output file.
Thank you Doudou, I will check my results.


Who's here now Members 0 Guests 0 Bots/Crawler 0

AWC's: 2.5.10 MediaWiki - Stand Alone Forum Extension
Forum theme style by: AWC
Retrieved from "http://www.nwchem-sw.org/index.php/Special:AWCforum/sp/id2343"